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105889-45-0

Basic Information
CAS No.: 105889-45-0
Name: 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid,3-[[(aminocarbonyl)oxy]methyl]-7-[[(2Z)-2-(2-amino-4-thiazolyl)-1-oxo-2-penten-1-yl]amino]-8-oxo-,(2,2-dimethyl-1-oxopropoxy)methyl ester, (6R,7R)-
Article Data: 3
Cas Database
Molecular Structure:
Molecular Structure of 105889-45-0 (5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid,3-[[(aminocarbonyl)oxy]methyl]-7-[[(2Z)-2-(2-amino-4-thiazolyl)-1-oxo-2-penten-1-yl]amino]-8-oxo-,(2,2-dimethyl-1-oxopropoxy)methyl ester, (6R,7R)-)
Formula: C23H29N5O8S2
Molecular Weight: 567.644
Synonyms: 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid,3-[[(aminocarbonyl)oxy]methyl]-7-[[(2Z)-2-(2-amino-4-thiazolyl)-1-oxo-2-pentenyl]amino]-8-oxo-,(2,2-dimethyl-1-oxopropoxy)methyl ester, (6R,7R)- (9CI);5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid,3-[[(aminocarbonyl)oxy]methyl]-7-[[2-(2-amino-4-thiazolyl)-1-oxo-2-pentenyl]amino]-8-oxo-,(2,2-dimethyl-1-oxopropoxy)methyl ester, [6R-[6a,7b(Z)]]-;Cefcamate pivoxil;Flumax;S 1108;Cefcapene pivoxil;
EINECS: 1806241-263-5
Density: 1.47 g/cm3
Melting Point: 158-164°C
Boiling Point: 888.4 °C at 760 mmHg
Flash Point: 491.1 °C
Solubility: N/A
Appearance: N/A
Hazard Symbols: N/A
Risk Codes: N/A
Safety:
Transport Information: N/A
PSA: 246.78000
LogP: 2.96830
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  • Cefcapene pivoxil

  • Casno:

    105889-45-0

    Cefcapene pivoxil

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0/

    high purity lowest priceAppearance:solid or liquid Storage:in sealed air resistant place Package:drum and bag Application:for pharma use Transportation:by sea or air Port:Beijing or Guangzhou

    Kono Chem Co.,Ltd is a leading producer of standardized herbal extracts, natural active ingredients and APIs for pharmaceutical, health food and cosmetic industries. Annually, mo

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  • Cefcapene pivoxil

  • Casno:

    105889-45-0

    Cefcapene pivoxil

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0/

    high purity,in stock Package:25kg/drum,or as per customers'demand Application:API,or Intermediates,fine chemicals Transportation:air,sea,courier

    GIHI CHEMICALS CO.,LIMITED, its former company is a small manufacturer who is specialized in the production of ester products which are used in the daily chemicals ,cosmetic produc

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  • Cefcapene Pivoxil

  • Casno:

    105889-45-0

    Cefcapene Pivoxil

    Min.Order: 100 Gram

    FOB Price:  USD $ 0.0-0.0/Gram

    Jinhua huayi chemical co., ltd. is dedicated to the development, production and marketing of chemicals. On the basis of equality and mutual benefit, and under the principle of customer first, credit first, quality first, we are ready to join hands

    Jinhua huayi chemical co., ltd. has own manufacturers which focus on production of organic specialty products,Pharmaceuticals and its intermediates,fine chemcals of high purity.The

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Specification

This chemical is called Cefcapene pivoxil, and its systematic name is 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-(((aminocarbonyl)oxy)methyl)-7-(((2Z)-2-(2-amino-4-thiazolyl)-1-oxo-2-pentenyl)amino)-8-oxo-, (2,2-dimethyl-1-oxopropoxy)methyl ester, (6R,7R)-. With CAS registry number 105889-45-0, its product categories are Chiral Reagents; Intermediates & Fine Chemicals; Pharmaceuticals. Additionally, it's an oral cephem antibiotic and prodrug of S-1006.

Other characteristics of the Cefcapene pivoxil can be summarised as followings: (1)ACD/LogP: 1.10; (2)# of Rule of 5 Violations: 3; (3)ACD/LogD (pH 5.5): 1.02; (4)ACD/LogD (pH 7.4): 1.1; (5)ACD/BCF (pH 5.5): 3.39; (6)ACD/BCF (pH 7.4): 4.02; (7)ACD/KOC (pH 5.5): 79.41; (8)ACD/KOC (pH 7.4): 94.22; (9)#H bond acceptors: 13; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 13; (12)Polar Surface Area: 192.43 Å2; (13)Index of Refraction: 1.638; (14)Molar Refractivity: 138.91 cm3; (15)Molar Volume: 386.1 cm3; (16)Polarizability: 55.07×10-24cm3; (17)Surface Tension: 74.4 dyne/cm; (18)Density: 1.47 g/cm3; (19)Flash Point: 491.1 °C; (20)Enthalpy of Vaporization: 129.15 kJ/mol; (21)Boiling Point: 888.4 °C at 760 mmHg; (22)Vapour Pressure: 3.51E-32 mmHg at 25°C.

This chemical could be obtained by the raw materials of compound (I) and compound (I), the synthesis of this chemcial is as follows:

Uses of this chemical: This chemical is cephalosporins. It's used as the precursor drug. It will play a role when in the free acid dissociation. Additionally, it can be taken orally.

You can still convert the following datas into molecular structure: 
1.SMILES: O=C2N1/C(=C(\CS[C@@H]1[C@@H]2NC(=O)C(=C/CC)\c3nc(sc3)N)COC(=O)N)C(=O)OCOC(=O)C(C)(C)C
2.InChI: InChI=1/C23H29N5O8S2/c1-5-6-12(13-9-38-21(24)26-13)16(29)27-14-17(30)28-15(11(7-34-22(25)33)8-37-18(14)28)19(31)35-10-36-20(32)23(2,3)4/h6,9,14,18H,5,7-8,10H2,1-4H3,(H2,24,26)(H2,25,33)(H,27,29)/b12-6-/t14-,18-/m1/s1
3.InChIKey: WVPAABNYMHNFJG-QDVBXLKVBG